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Information card for entry 8101659
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| Coordinates | 8101659.cif |
|---|
| Formula | C19 H24 I N O2 |
|---|---|
| Calculated formula | C19 H24 I N O2 |
| Title of publication | Crystal structure of 1-benzyl-2-methyl-3-carbethoxy-7<i>S</i>-iodo- 4,5,6,7-3a(<i>R</i>),7a(<i>S</i>)-hexahydroindole, C~19~H~24~INO~2~ |
| Authors of publication | Zukerman-Schpector, J.; Carvalho, Cristina C.; Ferraz, Helena M.C.; Pereira, Fernando L.C.; Zinner, L.B.; Vicentini, G. |
| Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
| Year of publication | 1998 |
| Journal volume | 213 |
| Journal issue | 4 |
| Pages of publication | 735 - 736 |
| a | 5.4734 ± 0.0003 Å |
| b | 11.8407 ± 0.0007 Å |
| c | 28.508 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1847.57 ± 0.24 Å3 |
| Ambient diffraction temperature | 191 ± 1 K |
| Number of distinct elements | 5 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for significantly intense reflections | 0.0315 |
| Weighted residual factors for significantly intense reflections | 0.0803 |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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